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Reference substances

Reference substances

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General information

Inventory

EC number:
250-575-9
EC name:
2,2-dimethyl-1,3-propanediyl dioctanoate
CAS number:
31335-74-7

No inventory information available

Reference substance information

IUPAC name:
2,2-dimethyl-3-(octanoyloxy)propyl octanoate
Synonyms
Names:
Octanoic acid, 2,2-dimethyl-1,3-propanediyl ester
2,2-dimethylpropane-1,3-diyl dioctanoate

CAS information

CAS number:
31335-74-7

Molecular and structural information

Molecular formula:
C21H40O4
Molecular weight:
356.54
SMILES notation:
CCCCCCCC(=O)OCC(C)(C)COC(=O)CCCCCCC
InChl:
InChI=1/C21H40O4/c1-5-7-9-11-13-15-19(22)24-17-21(3,4)18-25-20(23)16-14-12-10-8-6-2/h5-18H2,1-4H3
Structural formula:
Chemical structure